ChemSpider 2D Image | 5'-O-[Hydroxy(2-phenylacetoxy)phosphoryl]-8-hydroadenosine | C18H22N5O8P

5'-O-[Hydroxy(2-phenylacetoxy)phosphoryl]-8-hydroadenosine

  • Molecular FormulaC18H22N5O8P
  • Average mass467.370 Da
  • Monoisotopic mass467.120605 Da
  • ChemSpider ID61714239

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

5'-O-[(S)-Hydroxy(2-phenylacetoxy)phosphoryl]-8-hydroadenosin [German] [ACD/IUPAC Name]
5'-O-[(S)-Hydroxy(2-phenylacetoxy)phosphoryl]-8-hydroadenosine [ACD/IUPAC Name]
5'-O-[(S)-Hydroxy(2-phénylacétoxy)phosphoryl]-8-hydroadénosine [French] [ACD/IUPAC Name]
5'-O-[Hydroxy(2-phenylacetoxy)phosphoryl]-8-hydroadenosin [German] [ACD/IUPAC Name]
5'-O-[Hydroxy(2-phenylacetoxy)phosphoryl]-8-hydroadenosine [ACD/IUPAC Name]
5'-O-[Hydroxy(2-phénylacétoxy)phosphoryl]-8-hydroadénosine [French] [ACD/IUPAC Name]
8-Hydroadenosine, 5'-O-[(S)-hydroxy[(2-phenylacetyl)oxy]phosphinyl]- [ACD/Index Name]
8-Hydroadenosine, 5'-O-[hydroxy[(2-phenylacetyl)oxy]phosphinyl]- [ACD/Index Name]
5'-O-[hydroxy(Phenylacetyl)phosphoryl]adenosine
DLL

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.6±0.1 g/cm3
Boiling Point: 786.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 120.0±3.0 kJ/mol
Flash Point: 429.3±35.7 °C
Index of Refraction: 1.675
Molar Refractivity: 108.2±0.3 cm3
#H bond acceptors: 13
#H bond donors: 6
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: -0.09
ACD/LogD (pH 5.5): -3.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.90
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 199 Å2
Polarizability: 42.9±0.5 10-24cm3
Surface Tension: 91.7±3.0 dyne/cm
Molar Volume: 288.0±3.0 cm3

Click to predict properties on the Chemicalize site


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